Geometry & MOs

Info

ID:	31723
PubChem CID:	3288049
Reduced:	BrN3O6C23H26 (1)
Stoich.:	AB3C6D23E26 (1)
Weight, g/mol:	374.272199
ΔH_f, kcal/mol:	-178.08
Dipole, Da:	2.55
IP(EA), eV:	-8.7(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2,6-dimethylpiperidin-1-yl)methyl]-7-methyl-2-(4-propylphenyl)-1H-indole

Drug info:

PubChemData

Smile

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2)Br)OCC(=O)OCC

DOS

IR

Vibrations